SCHEMBL29231215

SCHEMBL29231215

CC(C)c1ccc(C(NC(=O)C2CC(F)CN2C(=O)Cc2nc(C(F)(F)F)co2)c2ccccc2)nc1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PSMB9 P28065 1/20 0.33
▸ CFD P00746 14/20 0.33
▸ XIAP P98170 5/20 0.33
▸ BIRC3 Q13489 4/20 0.31
▸ BIRC2 Q13490 4/20 0.31
▸ BIRC8 Q96P09 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24665807 1.00 PSMB9 (0.33) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL29231075 0.93 CFD (0.36) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL24666074 0.93 CFD (0.36) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL30341259 0.89 CFD (0.34) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL26816644 0.89 CFD (0.34) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL29230954 0.89 CFD (0.34) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL29820322 0.89 CFD (0.34) PSMB9CFDXIAPBIRC3BIRC2
SCHEMBL24664507 0.88 PSMB9 (0.34) PSMB9CFDXIAP
SCHEMBL29230960 0.88 PSMB9 (0.34) PSMB9CFDXIAP
SCHEMBL24665924 0.88 CFD (0.33) PSMB9CFD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117956985-A Inhibitors of glycogen synthase 1 (GYS 1) and methods of use thereof 梅兹治疗公司 2024-04-30 — — CN disclosed
EP-4308095-A1 INHIBITORS OF GLYCOGEN SYNTHASE 1 (GYS1) AND METHODS OF USE THEREOF Maze Therapeutics, Inc. (US) 2024-01-24 — — EP disclosed
WO-2022198196-A1 INHIBITORS OF GLYCOGEN SYNTHASE 1 (GYS1) AND METHODS OF USE THEREOF MAZE THERAPEUTICS, INC. (US) 2022-09-22 — — WO disclosed
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